==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 09-APR-12 4EKN . COMPND 2 MOLECULE: ASPARTATE CARBAMOYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOCALDOCOCCUS JANNASCHII; . AUTHOR J.VITALI . 304 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14097.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 221 72.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 13.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 23 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 103 33.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 1 0 0 0 1 1 0 3 0 1 0 1 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 2 2 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 B M 0 0 42 0, 0.0 301,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 112.0 22.7 20.8 4.1 2 2 B K - 0 0 153 1,-0.2 2,-0.3 118,-0.0 119,-0.2 0.899 360.0 -2.1 -78.7 -43.3 23.0 24.2 5.7 3 3 B H - 0 0 47 117,-0.2 2,-0.3 119,-0.0 119,-0.2 -0.869 57.2-132.4-137.9 172.3 24.7 22.9 8.9 4 4 B L B +a 122 0A 2 117,-2.7 119,-2.5 -2,-0.3 129,-0.1 -0.762 47.3 141.4-127.8 86.2 25.9 19.7 10.6 5 5 B I - 0 0 9 -2,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.846 66.4 -5.1 -95.7 -40.8 24.5 19.9 14.1 6 6 B S > - 0 0 8 125,-0.1 3,-2.5 126,-0.1 -1,-0.3 -0.987 57.5-118.8-159.5 145.6 23.4 16.4 15.0 7 7 B M G > S+ 0 0 0 -2,-0.3 3,-1.7 1,-0.3 -1,-0.1 0.752 108.6 75.1 -55.2 -24.8 23.0 13.0 13.4 8 8 B K G 3 S+ 0 0 113 1,-0.3 -1,-0.3 -3,-0.0 3,-0.0 0.627 87.6 63.0 -62.7 -12.2 19.3 13.3 14.2 9 9 B D G < S+ 0 0 82 -3,-2.5 2,-0.4 1,-0.0 -1,-0.3 0.526 97.6 58.2 -95.3 -6.9 19.1 15.8 11.3 10 10 B I < - 0 0 11 -3,-1.7 2,-0.1 -4,-0.2 -1,-0.0 -0.968 67.0-140.0-133.6 144.0 20.0 13.4 8.4 11 11 B G > - 0 0 38 -2,-0.4 4,-2.3 1,-0.0 3,-0.2 -0.391 37.6 -91.4 -94.9 170.6 18.7 10.2 7.0 12 12 B K H > S+ 0 0 64 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.897 123.3 51.1 -42.2 -56.1 20.3 7.0 5.6 13 13 B E H > S+ 0 0 123 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.909 111.4 46.2 -54.4 -48.0 20.4 8.3 2.0 14 14 B E H > S+ 0 0 50 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.829 111.4 53.4 -67.2 -31.4 22.0 11.6 3.0 15 15 B I H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.918 109.0 48.5 -65.7 -43.6 24.5 9.7 5.1 16 16 B L H X S+ 0 0 43 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.881 108.2 54.9 -65.5 -38.7 25.4 7.4 2.2 17 17 B E H X S+ 0 0 97 -4,-2.4 4,-2.4 -5,-0.2 -1,-0.2 0.951 108.9 47.5 -55.1 -51.1 25.8 10.5 -0.0 18 18 B I H X S+ 0 0 2 -4,-2.1 4,-1.5 1,-0.2 -2,-0.2 0.869 111.6 51.7 -59.5 -37.7 28.3 11.9 2.5 19 19 B L H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.910 107.8 50.5 -66.8 -43.4 30.1 8.6 2.5 20 20 B D H X S+ 0 0 104 -4,-2.8 4,-1.7 1,-0.2 -2,-0.2 0.938 109.8 51.5 -57.2 -47.6 30.3 8.4 -1.3 21 21 B E H X S+ 0 0 47 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.848 108.2 52.9 -57.2 -35.7 31.8 11.9 -1.2 22 22 B A H X S+ 0 0 0 -4,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.884 103.6 55.0 -69.5 -39.5 34.3 10.7 1.4 23 23 B R H X S+ 0 0 95 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.860 108.9 50.1 -60.5 -35.0 35.4 7.8 -0.8 24 24 B K H X S+ 0 0 111 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.908 108.2 51.3 -69.3 -42.9 36.1 10.4 -3.5 25 25 B M H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.873 107.6 54.5 -60.4 -36.7 38.2 12.5 -1.0 26 26 B E H X S+ 0 0 24 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.896 107.6 48.5 -67.3 -39.8 40.1 9.4 -0.1 27 27 B E H X S+ 0 0 73 -4,-1.6 4,-1.0 2,-0.2 -1,-0.2 0.922 108.9 54.1 -62.6 -44.6 41.0 8.7 -3.8 28 28 B L H >X>S+ 0 0 36 -4,-2.3 3,-0.7 1,-0.2 5,-0.5 0.904 109.0 48.2 -56.9 -42.8 42.1 12.3 -4.1 29 29 B L H ><5S+ 0 0 22 -4,-2.2 3,-1.3 1,-0.2 -1,-0.2 0.898 105.3 58.3 -62.7 -41.8 44.4 11.9 -1.2 30 30 B N H 3<5S+ 0 0 112 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.715 94.7 69.9 -60.3 -20.1 45.8 8.7 -2.7 31 31 B T H <<5S- 0 0 69 -4,-1.0 -1,-0.3 -3,-0.7 -2,-0.2 0.803 86.5-151.0 -69.7 -31.9 46.7 10.9 -5.7 32 32 B K T <<5 + 0 0 179 -3,-1.3 -3,-0.1 -4,-0.5 -2,-0.1 0.729 56.3 121.7 62.7 21.8 49.5 12.8 -3.8 33 33 B R S + 0 0 120 -2,-0.3 3,-2.1 1,-0.1 29,-0.1 0.163 42.6 122.2-120.4 15.5 42.5 22.9 -4.7 37 37 B L T 3 S+ 0 0 72 1,-0.3 29,-0.2 27,-0.2 -1,-0.1 0.847 89.9 25.9 -49.8 -42.5 38.9 22.1 -4.0 38 38 B L T > S+ 0 0 2 27,-3.1 3,-2.0 24,-0.2 30,-0.3 -0.042 85.1 151.4-114.8 31.7 38.6 24.7 -1.2 39 39 B E T < S+ 0 0 128 -3,-2.1 28,-0.2 1,-0.3 3,-0.1 -0.442 72.1 20.4 -62.7 130.0 41.4 27.0 -2.3 40 40 B G T 3 S+ 0 0 66 26,-0.6 2,-0.4 1,-0.3 -1,-0.3 0.424 100.0 118.1 89.4 -0.6 40.6 30.5 -1.0 41 41 B K < - 0 0 59 -3,-2.0 27,-3.1 25,-0.1 2,-0.5 -0.799 52.8-145.8-102.8 144.0 38.3 29.2 1.7 42 42 B I E -b 68 0A 53 -2,-0.4 56,-2.7 25,-0.2 57,-1.1 -0.925 4.2-158.5-116.1 123.4 38.8 29.7 5.4 43 43 B L E -bc 69 99A 0 25,-2.8 27,-2.6 -2,-0.5 2,-0.6 -0.840 10.5-152.9 -94.7 129.7 37.9 27.3 8.2 44 44 B A E -bc 70 100A 1 55,-3.2 57,-2.5 -2,-0.5 2,-0.8 -0.912 1.5-153.9-106.4 117.8 37.5 28.8 11.6 45 45 B T E -bc 71 101A 1 25,-2.8 27,-2.4 -2,-0.6 2,-0.6 -0.809 16.2-177.1 -89.1 111.3 38.1 26.4 14.6 46 46 B V E +bc 72 102A 0 55,-3.0 57,-2.3 -2,-0.8 2,-0.5 -0.876 9.2 164.1-118.3 101.0 36.1 27.7 17.5 47 47 B F E + c 0 103A 0 25,-3.4 57,-0.2 -2,-0.6 28,-0.1 -0.962 24.6 179.7-120.1 120.3 36.6 25.8 20.8 48 48 B Y S S+ 0 0 6 55,-2.3 27,-1.0 -2,-0.5 28,-0.3 0.787 87.1 43.0 -79.4 -30.3 35.6 27.1 24.2 49 49 B E S S- 0 0 29 54,-1.3 2,-0.1 25,-0.1 54,-0.1 -0.766 101.8 -95.8-110.4 159.1 36.9 23.8 25.5 50 50 B P + 0 0 85 0, 0.0 -2,-0.1 0, 0.0 24,-0.0 -0.428 44.7 155.2 -78.1 147.7 40.1 22.0 24.4 51 51 B S > + 0 0 4 -2,-0.1 4,-2.7 -4,-0.1 5,-0.2 -0.302 8.6 173.5-167.3 75.3 40.3 19.2 21.8 52 52 B T H > S+ 0 0 80 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.845 85.7 53.7 -51.8 -37.4 43.8 18.9 20.1 53 53 B R H > S+ 0 0 149 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.984 109.9 43.5 -63.0 -60.3 42.4 15.8 18.3 54 54 B T H > S+ 0 0 5 1,-0.2 4,-2.1 2,-0.2 5,-0.3 0.924 115.5 49.8 -50.4 -52.0 39.3 17.4 16.8 55 55 B R H X S+ 0 0 60 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.920 109.8 50.0 -56.6 -49.1 41.3 20.5 15.8 56 56 B L H X S+ 0 0 80 -4,-2.3 4,-2.9 -5,-0.2 -1,-0.2 0.928 111.1 47.7 -57.8 -49.8 44.1 18.6 14.1 57 57 B S H X S+ 0 0 17 -4,-2.2 4,-3.0 2,-0.2 -1,-0.2 0.940 116.1 42.1 -60.0 -52.0 41.9 16.4 12.0 58 58 B F H X S+ 0 0 0 -4,-2.1 4,-2.9 -5,-0.2 5,-0.2 0.896 115.0 51.7 -61.7 -40.2 39.6 19.2 10.7 59 59 B E H X S+ 0 0 30 -4,-2.6 4,-2.1 -5,-0.3 -2,-0.2 0.906 112.3 46.1 -64.3 -41.3 42.7 21.4 10.2 60 60 B T H X S+ 0 0 54 -4,-2.9 4,-2.6 -5,-0.2 -2,-0.2 0.939 112.2 51.2 -63.0 -48.6 44.3 18.6 8.2 61 61 B A H X S+ 0 0 0 -4,-3.0 4,-0.9 1,-0.2 -2,-0.2 0.928 112.3 45.7 -54.9 -49.3 41.1 18.0 6.2 62 62 B M H <>S+ 0 0 0 -4,-2.9 5,-2.4 1,-0.2 3,-0.4 0.896 114.3 47.9 -63.4 -41.6 40.8 21.7 5.3 63 63 B K H ><5S+ 0 0 101 -4,-2.1 3,-1.6 1,-0.2 -1,-0.2 0.829 105.2 58.6 -71.3 -30.7 44.5 22.0 4.4 64 64 B R H 3<5S+ 0 0 136 -4,-2.6 -29,-0.5 1,-0.3 -1,-0.2 0.756 103.7 54.5 -65.6 -24.9 44.3 18.8 2.2 65 65 B L T 3<5S- 0 0 0 -4,-0.9 -27,-3.1 -3,-0.4 -1,-0.3 0.250 124.5-106.7 -92.4 11.4 41.6 20.6 0.3 66 66 B G T < 5S+ 0 0 24 -3,-1.6 -26,-0.6 1,-0.2 -3,-0.2 0.578 79.4 132.1 76.1 10.5 43.9 23.6 -0.3 67 67 B G < - 0 0 3 -5,-2.4 2,-0.2 -28,-0.2 -1,-0.2 -0.262 52.8-117.1 -88.8 176.7 42.0 25.7 2.2 68 68 B E E -b 42 0A 116 -27,-3.1 -25,-2.8 -30,-0.3 2,-0.4 -0.702 19.5-151.0-111.2 165.3 43.1 27.9 5.1 69 69 B V E -b 43 0A 24 -2,-0.2 2,-0.4 -27,-0.2 -25,-0.2 -0.986 9.2-169.0-142.6 129.3 42.5 27.6 8.8 70 70 B I E -b 44 0A 69 -27,-2.6 -25,-2.8 -2,-0.4 2,-0.4 -0.929 22.4-144.9-110.8 145.5 42.3 30.1 11.7 71 71 B T E +b 45 0A 69 -2,-0.4 2,-0.3 -27,-0.2 -25,-0.2 -0.897 27.4 169.4-122.9 137.7 42.2 28.8 15.2 72 72 B M E +b 46 0A 54 -27,-2.4 -25,-3.4 -2,-0.4 3,-0.1 -0.782 18.4 152.1-143.7 92.3 40.5 29.8 18.5 73 73 B T + 0 0 59 -2,-0.3 2,-0.7 -27,-0.2 -1,-0.1 0.760 54.3 61.6-102.1 -31.4 40.8 27.2 21.1 74 74 B D + 0 0 77 1,-0.1 -26,-0.2 2,-0.1 -1,-0.2 -0.890 44.1 138.6-105.4 112.5 40.7 28.9 24.5 75 75 B L > + 0 0 0 -27,-1.0 5,-0.7 -2,-0.7 4,-0.3 0.101 46.4 98.6-132.9 17.5 37.5 30.7 25.3 76 76 B K T 5S- 0 0 122 -28,-0.3 -28,-0.1 4,-0.1 -27,-0.1 0.647 118.9 -6.8 -75.4 -15.5 37.2 29.6 28.9 77 77 B S T 5S+ 0 0 70 3,-0.1 -2,-0.1 4,-0.1 -1,-0.1 0.320 120.3 83.9-155.5 -6.6 38.7 33.0 29.7 78 78 B S T 5S- 0 0 56 -30,-0.1 -3,-0.1 3,-0.1 6,-0.1 0.657 126.4 -18.0 -80.6 -17.7 39.7 34.5 26.3 79 79 B S T 5S+ 0 0 5 -4,-0.3 4,-0.3 4,-0.1 -3,-0.1 0.334 133.3 67.1-160.4 -19.6 36.2 35.8 25.8 80 80 B V S > - 0 0 56 -3,-0.1 4,-1.9 1,-0.1 3,-0.6 -0.328 24.8-104.2 -76.0 165.2 28.9 36.0 24.5 86 86 B L H 3> S+ 0 0 20 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.932 119.4 54.4 -54.4 -51.0 28.8 33.0 22.2 87 87 B I H 3> S+ 0 0 37 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.773 108.0 51.0 -60.2 -28.1 26.5 34.7 19.7 88 88 B D H <> S+ 0 0 69 -3,-0.6 4,-2.4 2,-0.2 -1,-0.2 0.933 110.8 46.8 -71.4 -48.1 28.8 37.7 19.4 89 89 B T H X S+ 0 0 2 -4,-1.9 4,-2.7 1,-0.2 5,-0.2 0.909 111.1 52.4 -60.4 -44.5 31.9 35.6 18.7 90 90 B I H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 28,-0.2 0.920 110.4 48.2 -57.0 -46.4 30.0 33.5 16.1 91 91 B R H X S+ 0 0 110 -4,-1.5 4,-0.8 -5,-0.2 -2,-0.2 0.909 113.1 46.6 -63.7 -44.0 28.9 36.6 14.3 92 92 B V H X S+ 0 0 62 -4,-2.4 4,-1.1 1,-0.2 3,-0.3 0.925 117.3 44.1 -62.1 -43.9 32.4 38.1 14.3 93 93 B I H X S+ 0 0 13 -4,-2.7 4,-3.2 1,-0.2 -2,-0.2 0.826 107.1 56.3 -76.1 -33.2 33.9 34.9 13.1 94 94 B S H < S+ 0 0 2 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.692 107.1 54.3 -70.9 -16.0 31.3 34.0 10.5 95 95 B G H < S+ 0 0 49 -4,-0.8 -2,-0.2 -3,-0.3 -1,-0.2 0.808 114.3 39.3 -80.7 -33.7 32.2 37.5 9.1 96 96 B Y H < S+ 0 0 165 -4,-1.1 -2,-0.2 -5,-0.1 -3,-0.1 0.923 119.0 40.8 -77.4 -48.6 35.9 36.5 8.9 97 97 B A < - 0 0 5 -4,-3.2 -54,-0.2 -5,-0.1 3,-0.1 -0.218 65.6-133.4-102.5-176.1 35.6 32.9 7.8 98 98 B D S S+ 0 0 52 -56,-2.7 2,-0.3 1,-0.4 -55,-0.2 0.526 89.7 8.2-111.8 -14.9 33.6 30.7 5.4 99 99 B I E -c 43 0A 0 -57,-1.1 -55,-3.2 20,-0.2 2,-0.4 -0.969 65.8-143.6-166.3 151.4 32.9 27.8 7.8 100 100 B I E -cd 44 121A 0 20,-2.3 22,-2.9 -2,-0.3 2,-0.6 -0.975 7.1-158.4-131.1 134.6 33.2 27.0 11.5 101 101 B V E -cd 45 122A 0 -57,-2.5 -55,-3.0 -2,-0.4 2,-0.4 -0.955 28.7-165.6-105.4 117.6 33.9 24.0 13.6 102 102 B L E +cd 46 123A 0 20,-3.1 22,-2.9 -2,-0.6 2,-0.4 -0.883 23.3 179.0-116.7 133.3 32.5 24.6 17.0 103 103 B R E +c 47 0A 34 -57,-2.3 -55,-2.3 -2,-0.4 -54,-1.3 -0.892 20.6 160.6-129.5 102.6 33.1 22.8 20.4 104 104 B H - 0 0 25 21,-1.0 5,-0.3 -2,-0.4 6,-0.2 -0.986 38.5-139.6-132.3 129.1 31.1 24.4 23.2 105 105 B P S S+ 0 0 60 0, 0.0 23,-0.2 0, 0.0 -1,-0.1 0.814 74.4 94.3 -54.3 -41.9 30.2 22.9 26.6 106 106 B S S > S- 0 0 64 21,-0.1 3,-1.5 1,-0.1 4,-0.3 -0.230 84.2-107.5 -62.5 139.1 26.6 24.4 26.8 107 107 B E T 3 S+ 0 0 176 1,-0.3 20,-0.1 2,-0.1 -1,-0.1 -0.315 103.8 12.7 -60.7 145.7 23.7 22.2 25.6 108 108 B G T 3> S+ 0 0 43 18,-0.3 4,-2.1 1,-0.1 -1,-0.3 0.672 89.5 131.7 59.4 16.6 22.2 23.3 22.3 109 109 B A H <> + 0 0 3 -3,-1.5 4,-2.5 -5,-0.3 5,-0.2 0.953 69.8 45.7 -63.1 -51.7 25.2 25.6 21.8 110 110 B A H > S+ 0 0 0 -4,-0.3 4,-2.2 -6,-0.2 -1,-0.2 0.856 111.8 53.3 -61.1 -37.0 26.0 24.5 18.2 111 111 B R H > S+ 0 0 97 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.935 110.1 46.2 -64.8 -47.9 22.3 24.9 17.3 112 112 B L H >X S+ 0 0 60 -4,-2.1 4,-1.2 1,-0.2 3,-0.9 0.932 110.7 54.3 -58.9 -47.3 22.1 28.4 18.6 113 113 B A H >X S+ 0 0 0 -4,-2.5 4,-1.4 1,-0.3 3,-0.8 0.911 103.1 55.2 -53.1 -46.9 25.3 29.3 16.9 114 114 B S H 3< S+ 0 0 16 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.789 103.8 58.0 -59.6 -26.4 23.9 28.1 13.5 115 115 B E H << S+ 0 0 133 -4,-1.0 -1,-0.3 -3,-0.9 -2,-0.2 0.850 115.4 33.0 -71.4 -35.4 21.1 30.5 14.1 116 116 B Y H << S+ 0 0 95 -4,-1.2 2,-0.4 -3,-0.8 -2,-0.2 0.451 101.1 97.8 -99.9 -3.6 23.4 33.5 14.3 117 117 B S < - 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0 0 85 -3,-0.8 3,-0.1 -30,-0.2 -6,-0.1 -0.411 59.6 -77.2 -78.0 155.5 24.8 -0.7 30.5 191 191 B L - 0 0 3 1,-0.1 -30,-0.2 -2,-0.1 -1,-0.1 -0.234 63.6 -90.3 -50.1 133.1 23.3 1.1 27.6 192 192 B P >> - 0 0 28 0, 0.0 4,-1.7 0, 0.0 3,-0.7 -0.202 34.2-129.8 -48.7 132.6 20.9 3.8 28.7 193 193 B K H 3> S+ 0 0 94 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.868 103.7 62.2 -59.5 -41.7 17.4 2.3 28.9 194 194 B D H 3> S+ 0 0 103 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.895 106.0 48.1 -52.0 -41.9 15.7 5.1 26.8 195 195 B I H <> S+ 0 0 22 -3,-0.7 4,-2.5 2,-0.2 -1,-0.2 0.947 105.8 56.8 -61.5 -49.6 18.0 4.1 24.0 196 196 B I H X S+ 0 0 1 -4,-1.7 4,-2.6 1,-0.2 -2,-0.2 0.880 106.3 52.2 -47.0 -41.7 17.1 0.4 24.5 197 197 B E H X S+ 0 0 91 -4,-2.4 4,-2.8 2,-0.2 -1,-0.2 0.926 106.1 52.1 -61.4 -47.0 13.5 1.6 24.0 198 198 B D H X S+ 0 0 70 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.898 111.7 47.5 -56.4 -43.0 14.3 3.3 20.7 199 199 B L H <>S+ 0 0 2 -4,-2.5 5,-2.6 2,-0.2 4,-0.2 0.935 111.3 49.5 -64.3 -48.5 15.9 0.1 19.5 200 200 B K H ><5S+ 0 0 117 -4,-2.6 3,-1.0 3,-0.2 -2,-0.2 0.908 112.4 49.1 -56.3 -43.8 13.0 -2.1 20.6 201 201 B A H 3<5S+ 0 0 75 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.942 110.1 48.8 -62.3 -49.7 10.6 0.4 18.8 202 202 B K T 3<5S- 0 0 91 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.464 115.6-123.7 -68.6 0.6 12.7 0.3 15.6 203 203 B N T < 5 + 0 0 143 -3,-1.0 2,-0.4 -4,-0.2 -3,-0.2 0.909 48.6 170.0 56.1 46.9 12.5 -3.5 16.1 204 204 B I < - 0 0 24 -5,-2.6 2,-0.6 -6,-0.1 -1,-0.2 -0.749 37.4-122.8 -90.1 134.3 16.3 -3.9 16.1 205 205 B K + 0 0 123 -2,-0.4 -24,-2.1 -26,-0.4 2,-0.3 -0.667 50.8 153.8 -76.0 115.7 17.7 -7.3 17.0 206 206 B F E -g 181 0B 36 -2,-0.6 2,-0.4 -26,-0.2 -24,-0.2 -0.966 29.7-154.7-145.0 159.8 20.1 -6.6 20.0 207 207 B Y E -g 182 0B 81 -26,-2.3 -24,-3.2 -2,-0.3 2,-0.6 -0.997 13.1-142.2-138.0 140.3 21.6 -8.3 23.0 208 208 B E E -g 183 0B 51 -2,-0.4 2,-0.3 -26,-0.2 -24,-0.2 -0.914 30.3-172.0 -99.4 117.0 22.9 -7.1 26.4 209 209 B K E -g 184 0B 64 -26,-2.0 -24,-1.5 -2,-0.6 3,-0.1 -0.834 26.1-157.0-114.9 150.1 25.9 -9.2 27.3 210 210 B E S S+ 0 0 114 -2,-0.3 2,-0.3 -26,-0.2 -1,-0.1 0.810 75.9 32.7 -89.7 -34.6 28.0 -9.4 30.5 211 211 B S > - 0 0 36 1,-0.1 3,-0.6 -27,-0.1 -1,-0.1 -0.846 68.3-126.1-129.3 158.9 31.2 -10.8 29.1 212 212 B L G > S+ 0 0 11 32,-0.4 3,-1.4 -2,-0.3 -1,-0.1 0.795 111.8 61.6 -67.3 -30.3 33.4 -10.8 26.0 213 213 B D G 3 S+ 0 0 128 1,-0.3 -1,-0.2 -3,-0.0 0, 0.0 0.700 87.3 72.1 -71.3 -19.5 33.3 -14.6 26.0 214 214 B D G < S+ 0 0 54 -3,-0.6 2,-0.4 2,-0.0 -1,-0.3 0.518 83.7 92.7 -72.6 -4.0 29.5 -14.4 25.5 215 215 B L < - 0 0 17 -3,-1.4 2,-0.1 -4,-0.1 -60,-0.0 -0.775 65.9-152.4 -93.3 134.2 30.3 -13.3 22.0 216 216 B D > - 0 0 116 -2,-0.4 3,-0.9 1,-0.0 2,-0.2 -0.414 35.9 -97.4 -90.3 176.0 30.5 -15.8 19.2 217 217 B D T 3 S+ 0 0 68 1,-0.2 39,-0.1 -2,-0.1 -1,-0.0 -0.092 103.1 92.0 -90.1 36.7 32.6 -15.3 16.1 218 218 B D T 3 + 0 0 34 -2,-0.2 -65,-0.2 38,-0.0 -1,-0.2 0.537 57.0 111.1-100.6 -11.1 29.7 -14.0 14.0 219 219 B I < - 0 0 1 -3,-0.9 -65,-0.2 1,-0.1 37,-0.1 -0.439 47.7-169.3 -66.9 132.1 30.4 -10.4 14.9 220 220 B D S S+ 0 0 28 -67,-3.0 38,-1.5 1,-0.3 2,-0.4 0.751 71.9 32.9 -92.2 -29.8 31.7 -8.3 12.0 221 221 B V E -fh 154 258B 0 -68,-1.8 -66,-2.8 36,-0.3 2,-0.7 -0.980 57.8-163.3-138.4 125.4 32.7 -5.2 14.0 222 222 B L E -fh 155 259B 0 36,-3.5 38,-3.2 -2,-0.4 2,-0.7 -0.903 13.4-172.2-106.3 107.1 34.1 -4.8 17.5 223 223 B Y E -fh 156 260B 0 -68,-2.9 -66,-1.8 -2,-0.7 2,-0.4 -0.867 7.8-167.1-104.4 108.5 33.8 -1.2 18.6 224 224 B V E -f 157 0B 3 36,-3.0 2,-0.2 -2,-0.7 -66,-0.2 -0.795 6.1-176.0-104.9 136.3 35.6 -0.6 21.9 225 225 B T - 0 0 3 -68,-3.1 2,-0.1 -2,-0.4 -65,-0.1 -0.719 30.8 -82.3-122.2 175.3 35.2 2.5 24.2 226 226 B R - 0 0 73 -2,-0.2 -67,-1.1 -68,-0.2 2,-0.5 -0.398 18.9-157.1 -81.7 147.8 36.8 3.8 27.4 227 227 B I - 0 0 15 -69,-0.2 15,-0.1 -2,-0.1 -1,-0.0 -0.854 27.8-148.5-119.0 93.8 36.0 2.9 30.9 228 228 B Q > - 0 0 112 -2,-0.5 3,-1.0 1,-0.1 4,-0.2 -0.048 18.6-119.7 -61.2 161.8 37.3 5.9 32.9 229 229 B K G > S+ 0 0 131 1,-0.2 3,-2.6 2,-0.2 -1,-0.1 0.792 105.4 76.8 -72.9 -28.8 38.6 5.6 36.5 230 230 B E G 3 S+ 0 0 152 1,-0.3 -1,-0.2 2,-0.1 -2,-0.1 0.619 88.7 62.6 -57.0 -10.9 35.9 8.0 37.8 231 231 B R G < S+ 0 0 51 -3,-1.0 -1,-0.3 1,-0.3 -2,-0.2 0.649 114.7 27.5 -89.8 -18.1 33.6 4.9 37.5 232 232 B F < - 0 0 12 -3,-2.6 -1,-0.3 -4,-0.2 6,-0.2 -0.653 63.0-179.8-146.5 84.2 35.6 2.9 40.0 233 233 B P + 0 0 117 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.781 66.6 85.7 -58.0 -31.1 37.5 5.0 42.6 234 234 B D S > S- 0 0 75 1,-0.2 4,-2.5 2,-0.0 3,-0.3 -0.647 71.1-154.1 -75.1 109.3 38.8 1.9 44.3 235 235 B P H > S+ 0 0 85 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.865 93.1 59.4 -50.4 -37.7 42.0 1.0 42.3 236 236 B N H > S+ 0 0 126 1,-0.2 4,-1.5 2,-0.2 3,-0.2 0.939 109.4 38.6 -57.4 -53.8 41.4 -2.6 43.4 237 237 B E H > S+ 0 0 78 -3,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.866 112.0 58.9 -67.0 -36.2 38.0 -3.0 41.8 238 238 B Y H X S+ 0 0 20 -4,-2.5 4,-2.5 -6,-0.2 5,-0.3 0.844 100.3 57.1 -63.1 -35.0 39.1 -0.9 38.8 239 239 B E H X S+ 0 0 125 -4,-1.9 4,-2.8 -5,-0.2 5,-0.2 0.978 106.6 50.2 -53.2 -57.6 41.8 -3.5 38.2 240 240 B K H X S+ 0 0 113 -4,-1.5 4,-1.8 2,-0.2 -2,-0.2 0.911 112.3 45.8 -45.5 -55.2 39.1 -6.1 38.0 241 241 B V H >X S+ 0 0 2 -4,-2.2 4,-1.6 2,-0.2 3,-0.5 0.963 113.5 46.7 -59.2 -58.8 37.0 -4.2 35.5 242 242 B K H >X S+ 0 0 59 -4,-2.5 4,-2.0 1,-0.2 3,-0.5 0.917 112.0 52.9 -47.0 -50.1 39.8 -3.2 33.2 243 243 B G H 3< S+ 0 0 46 -4,-2.8 -1,-0.2 -5,-0.3 -2,-0.2 0.855 109.0 49.3 -56.7 -37.5 41.1 -6.8 33.2 244 244 B S H << S+ 0 0 71 -4,-1.8 -32,-0.4 -3,-0.5 -1,-0.2 0.779 121.8 30.4 -76.0 -28.3 37.7 -8.2 32.3 245 245 B Y H << S+ 0 0 36 -4,-1.6 2,-0.3 -3,-0.5 -2,-0.2 0.464 85.4 116.2-115.4 -3.9 37.0 -5.9 29.3 246 246 B K < - 0 0 46 -4,-2.0 2,-0.5 -5,-0.2 23,-0.2 -0.509 68.4-123.9 -67.0 128.3 40.5 -5.2 28.0 247 247 B I B -j 269 0C 0 21,-2.9 23,-2.6 -2,-0.3 2,-0.3 -0.654 35.2-170.0 -76.2 123.6 40.9 -6.6 24.5 248 248 B K >> - 0 0 79 -2,-0.5 4,-1.1 21,-0.2 3,-0.6 -0.817 32.3-113.9-117.9 157.2 43.9 -9.0 24.4 249 249 B R H >> S+ 0 0 114 -2,-0.3 4,-2.7 1,-0.2 3,-1.0 0.902 112.6 54.4 -52.9 -51.3 45.8 -10.7 21.6 250 250 B E H 34 S+ 0 0 138 1,-0.3 -1,-0.2 2,-0.2 -3,-0.0 0.823 110.0 48.3 -58.2 -32.3 44.8 -14.3 22.5 251 251 B Y H <4 S+ 0 0 30 -3,-0.6 -1,-0.3 1,-0.2 -2,-0.2 0.728 114.7 46.8 -77.1 -23.1 41.1 -13.3 22.4 252 252 B V H X< S+ 0 0 0 -4,-1.1 3,-2.1 -3,-1.0 -2,-0.2 0.838 82.9 108.6 -89.3 -37.6 41.6 -11.6 19.0 253 253 B E T 3< S+ 0 0 106 -4,-2.7 3,-0.1 1,-0.3 -5,-0.0 -0.073 92.0 6.3 -44.3 135.0 43.5 -14.2 17.2 254 254 B G T 3 S+ 0 0 71 1,-0.2 -1,-0.3 2,-0.1 2,-0.2 0.625 95.7 143.2 66.2 15.1 41.5 -16.0 14.5 255 255 B K < - 0 0 52 -3,-2.1 -1,-0.2 1,-0.1 23,-0.1 -0.561 50.1-142.9 -87.5 152.8 38.5 -13.6 15.0 256 256 B K + 0 0 113 -2,-0.2 -1,-0.1 -37,-0.1 -36,-0.1 0.773 69.7 92.8 -81.1 -27.8 36.4 -12.4 12.1 257 257 B F - 0 0 6 -38,-0.1 2,-0.3 -36,-0.1 -36,-0.3 -0.093 66.7-134.2 -73.8 160.9 35.8 -8.9 13.4 258 258 B I E -h 221 0B 13 -38,-1.5 -36,-3.5 21,-0.0 2,-0.5 -0.798 26.9-127.0 -98.5 156.1 37.6 -5.6 12.8 259 259 B I E -hi 222 279B 0 19,-2.8 21,-1.5 -2,-0.3 22,-0.4 -0.928 24.2-171.1-111.6 123.2 38.3 -3.6 15.9 260 260 B M E +h 223 0B 0 -38,-3.2 -36,-3.0 -2,-0.5 21,-0.1 -0.901 9.9 170.2-113.9 142.8 37.2 0.1 16.0 261 261 B H - 0 0 0 -2,-0.4 -36,-0.1 -38,-0.2 24,-0.1 -0.933 30.6-144.3-151.6 121.3 38.2 2.6 18.7 262 262 B P - 0 0 15 0, 0.0 3,-0.1 0, 0.0 -37,-0.1 0.719 63.9-115.5 -61.7 -20.4 37.5 6.3 18.4 263 263 B L S S+ 0 0 41 1,-0.3 2,-0.1 -3,-0.0 -37,-0.1 0.283 91.2 106.4 72.4 156.0 40.8 7.0 20.3 264 264 B P - 0 0 82 0, 0.0 2,-0.6 0, 0.0 -1,-0.3 0.504 58.7-150.8 -71.2 152.5 42.7 7.9 22.2 265 265 B R + 0 0 29 1,-0.2 -40,-0.0 -2,-0.1 -4,-0.0 -0.846 31.9 152.4 -91.1 120.7 43.4 4.3 23.3 266 266 B V S S- 0 0 75 -2,-0.6 -1,-0.2 -3,-0.0 -40,-0.0 0.743 75.4 -19.7-108.0 -74.1 44.6 4.1 26.9 267 267 B D S S+ 0 0 36 1,-0.1 -2,-0.1 3,-0.1 3,-0.1 0.563 110.9 89.0-114.3 -16.8 43.8 0.8 28.6 268 268 B E S S+ 0 0 23 1,-0.1 -21,-2.9 -22,-0.1 2,-0.4 0.743 92.1 34.0 -62.3 -29.0 41.0 -0.7 26.5 269 269 B I B S-j 247 0C 1 -23,-0.2 -21,-0.2 -45,-0.1 -1,-0.1 -0.981 80.9-119.7-139.2 125.5 43.3 -2.6 24.0 270 270 B D >> - 0 0 50 -23,-2.6 3,-1.3 -2,-0.4 4,-0.6 -0.222 24.0-125.0 -58.3 146.8 46.6 -4.3 24.5 271 271 B Y G >4 S+ 0 0 155 1,-0.3 3,-0.8 2,-0.2 4,-0.4 0.804 107.5 64.3 -65.6 -29.9 49.5 -3.0 22.4 272 272 B D G 34 S+ 0 0 59 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.150 93.3 63.2 -84.3 22.1 50.2 -6.4 21.0 273 273 B V G X4 S+ 0 0 0 -3,-1.3 3,-2.4 -26,-0.1 6,-0.3 0.601 82.4 80.3-104.7 -28.6 46.8 -6.4 19.3 274 274 B D T << S+ 0 0 39 -3,-0.8 -2,-0.2 -4,-0.6 8,-0.1 0.837 92.8 47.9 -41.7 -45.8 47.9 -3.4 17.2 275 275 B D T 3 S+ 0 0 156 -4,-0.4 -1,-0.3 3,-0.1 -2,-0.1 0.473 87.7 105.9 -86.0 -2.0 49.7 -5.6 14.7 276 276 B L S X S- 0 0 33 -3,-2.4 3,-1.9 1,-0.1 -3,-0.1 -0.553 80.4-119.8 -76.2 144.2 46.9 -8.1 14.3 277 277 B P T 3 S+ 0 0 99 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.823 111.1 58.9 -51.3 -38.9 45.0 -7.9 11.0 278 278 B Q T 3 S+ 0 0 22 -20,-0.1 -19,-2.8 -23,-0.1 2,-0.5 0.659 79.6 103.1 -72.3 -14.7 41.7 -7.2 12.7 279 279 B A B < +i 259 0B 17 -3,-1.9 -19,-0.1 -6,-0.3 4,-0.1 -0.577 35.6 150.1 -70.5 118.1 43.1 -4.1 14.3 280 280 B K > + 0 0 48 -21,-1.5 4,-2.9 -2,-0.5 -1,-0.2 0.362 33.5 103.8-132.3 1.7 41.7 -1.2 12.3 281 281 B Y H > S+ 0 0 0 -22,-0.4 4,-1.9 1,-0.2 -21,-0.1 0.784 85.2 49.7 -63.3 -29.3 41.4 1.8 14.7 282 282 B F H > S+ 0 0 112 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.856 112.7 46.4 -77.4 -34.6 44.5 3.5 13.3 283 283 B K H > S+ 0 0 85 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.882 109.8 56.3 -66.4 -40.0 43.1 3.1 9.8 284 284 B Q H X S+ 0 0 2 -4,-2.9 4,-1.0 1,-0.2 -2,-0.2 0.919 103.5 54.2 -54.9 -47.3 39.9 4.3 11.2 285 285 B S H >< S+ 0 0 66 -4,-1.9 3,-0.8 1,-0.2 4,-0.4 0.916 108.0 48.7 -52.1 -49.3 41.7 7.4 12.4 286 286 B F H >< S+ 0 0 89 -4,-1.6 3,-2.6 1,-0.2 -2,-0.2 0.932 103.3 60.1 -59.7 -46.7 43.0 8.1 8.8 287 287 B Y H 3X S+ 0 0 2 -4,-2.5 4,-1.7 1,-0.3 -1,-0.2 0.757 90.2 74.2 -52.5 -25.6 39.5 7.6 7.4 288 288 B G H S+ 0 0 21 -3,-2.6 4,-2.2 -4,-0.4 -1,-0.2 0.947 106.0 45.9 -73.7 -50.9 40.4 12.9 7.2 290 290 B P H > S+ 0 0 0 0, 0.0 4,-2.2 0, 0.0 -2,-0.2 0.851 115.2 47.7 -60.4 -36.2 38.6 12.0 4.0 291 291 B V H X S+ 0 0 0 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.868 111.5 49.0 -76.9 -34.4 35.1 12.2 5.6 292 292 B R H X S+ 0 0 14 -4,-1.5 4,-2.9 -5,-0.2 -1,-0.2 0.855 110.2 54.2 -67.5 -33.1 35.9 15.5 7.2 293 293 B M H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.952 110.0 45.4 -60.3 -50.8 37.1 16.6 3.8 294 294 B A H X S+ 0 0 0 -4,-2.2 4,-3.2 2,-0.2 5,-0.2 0.924 113.7 50.2 -58.8 -46.7 33.8 15.6 2.3 295 295 B I H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 5,-0.2 0.951 112.9 45.5 -56.3 -53.8 31.9 17.3 5.1 296 296 B L H X S+ 0 0 0 -4,-2.9 4,-1.9 1,-0.2 -2,-0.2 0.952 116.5 45.5 -54.3 -53.8 33.9 20.5 4.7 297 297 B K H X S+ 0 0 35 -4,-2.9 4,-2.5 1,-0.2 5,-0.3 0.930 112.4 50.5 -57.1 -50.7 33.5 20.5 1.0 298 298 B K H X S+ 0 0 36 -4,-3.2 4,-2.9 1,-0.2 -1,-0.2 0.895 110.1 48.7 -57.2 -45.8 29.8 19.7 1.0 299 299 B L H X S+ 0 0 0 -4,-2.3 4,-0.5 -5,-0.2 -1,-0.2 0.865 112.5 48.8 -67.5 -37.0 28.8 22.4 3.5 300 300 B I H >< S+ 0 0 8 -4,-1.9 3,-0.7 -5,-0.2 -2,-0.2 0.958 118.0 39.3 -61.3 -52.6 30.8 25.1 1.5 301 301 B E H 3< S+ 0 0 87 -4,-2.5 3,-0.4 1,-0.2 -2,-0.2 0.824 109.3 58.5 -74.4 -33.7 29.2 24.1 -1.8 302 302 B D H 3< S+ 0 0 71 -4,-2.9 2,-0.3 -5,-0.3 -1,-0.2 0.692 109.6 50.9 -65.7 -17.5 25.7 23.5 -0.5 303 303 B N << 0 0 58 -3,-0.7 -1,-0.3 -4,-0.5 -2,-0.1 -0.604 360.0 360.0-128.4 72.1 25.7 27.1 0.7 304 304 B E 0 0 165 -3,-0.4 -2,-0.1 -2,-0.3 -1,-0.1 0.223 360.0 360.0-177.9 360.0 26.8 29.6 -2.0